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Details

Stereochemistry ACHIRAL
Molecular Formula C9H14N2O2S
Molecular Weight 214.285
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-ETHYL-5-ISOPROPYL-2-THIOBARBITURIC ACID

SMILES

CCC1(C(C)C)C(=O)NC(=S)NC1=O

InChI

InChIKey=BMPIYRKMKYJEHY-UHFFFAOYSA-N
InChI=1S/C9H14N2O2S/c1-4-9(5(2)3)6(12)10-8(14)11-7(9)13/h5H,4H2,1-3H3,(H2,10,11,12,13,14)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
NSC-120738
Preferred Name English
5-ETHYL-5-ISOPROPYL-2-THIOBARBITURIC ACID
Systematic Name English
4,6(1H,5H)-PYRIMIDINEDIONE, 5-ETHYLDIHYDRO-5-(1-METHYLETHYL)-2-THIOXO-
Systematic Name English
5-ETHYLDIHYDRO-5-(1-METHYLETHYL)-2-THIOXO-4,6(1H,5H)-PYRIMIDINEDIONE
Systematic Name English
BARBITURIC ACID, 5-ETHYL-5-ISOPROPYL-2-THIO-
Common Name English
Code System Code Type Description
PUBCHEM
3032937
Created by admin on Tue Apr 01 20:17:03 GMT 2025 , Edited by admin on Tue Apr 01 20:17:03 GMT 2025
PRIMARY
EPA CompTox
DTXSID10192905
Created by admin on Tue Apr 01 20:17:03 GMT 2025 , Edited by admin on Tue Apr 01 20:17:03 GMT 2025
PRIMARY
CAS
39847-06-8
Created by admin on Tue Apr 01 20:17:03 GMT 2025 , Edited by admin on Tue Apr 01 20:17:03 GMT 2025
PRIMARY
NSC
120738
Created by admin on Tue Apr 01 20:17:03 GMT 2025 , Edited by admin on Tue Apr 01 20:17:03 GMT 2025
PRIMARY
FDA UNII
CET3VV36DY
Created by admin on Tue Apr 01 20:17:03 GMT 2025 , Edited by admin on Tue Apr 01 20:17:03 GMT 2025
PRIMARY
NIH
NCATS
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